Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6558335 | 0.83 | ALDH1A1 (0.45) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL4358099 | 0.75 | MAOB (0.46) | ALDH1A1MAOBLMNATRPA1IDO1 | |
| SCHEMBL9444804 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL434609 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL9491570 | 0.72 | MAOB (0.48) | ALDH1A1MAOBLMNATRPA1IDO1 | |
| SCHEMBL6959115 | 0.69 | HTT (0.39) | ALDH1A1TSHRMAPT | |
| SCHEMBL8164 | 0.67 | — | — | |
| SCHEMBL4354058 | 0.67 | — | — | |
| SCHEMBL3855904 | 0.67 | — | — | |
| SCHEMBL18640421 | 0.67 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100364990-C | Substituted 4-amino-1- (pyridylmethyl) piperidines and related compounds | THERAVANCE INC (US) | 2008-01-30 | — | — | CN | disclosed |
| CN-1708494-A | Substituted 4-amino-1- (pyridylmethyl) piperidines and related compounds | THERAVANCE INC (US) | 2005-12-14 | — | — | CN | disclosed |
| US-6645909-B2 | Coupling reaction of a diazonium salt and a coupler to make diazonium salt form color | FUJI PHOTO FILM CO., LTD. (JP) | 2003-11-11 | — | — | US | disclosed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| US-20020077252-A1 | Process for azo coupling reaction using diazonium salt and coupler having releasing group, and recording material containing the coupler | FUJI PHOTO FILM CO., LTD. | 2002-06-20 | — | — | US | disclosed |